[(Prop-2-en-1-yl)sulfanyl]acetyl chloride
Basic information
- CAS
29431-25-2- Standard SMILES
C=CCSCC(=O)Cl- InChIKey
HIMGANHZFPYUOV-UHFFFAOYSA-N- Molecular formula
- C5H7ClOS
- Average molar mass
- 150.63 g/mol
- Monoisotopic mass
- 149.9906137
Names & identifiers
- Preferred name
- [(Prop-2-en-1-yl)sulfanyl]acetyl chloride
- IUPAC
- 2-prop-2-enylsulfanylacetyl chloride
Names & synonyms
29431-25-2NSC208881[(Prop-2-en-1-yl)sulfanyl]acetyl chlorideSCHEMBL9471474DTXSID70308762NSC-208881DS-006390ACETYL CHLORIDE,2-(2-PROPEN-1-YLTHIO)-
Database identifiers
- CAS
29431-25-2- PubChem CID
- 308196
- DTXSID
DTXSID70308762
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 92.4
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Compound notes
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